Mol:LBF11000BC04
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 14 13 0 0 1 0 0 0 0 0999 V2000 -3.7570 1.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3392 1.6421 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8033 1.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3392 2.6298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3459 1.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 2.3541 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 0.9301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1447 1.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7337 0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1447 0.2181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7337 -0.4939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1447 -1.2059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7337 -1.9179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1447 -2.6298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 2 4 1 4 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 1 8 1 0 0 0 0 2 14 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 S SKP 5 ID LBF11000BC04 FORMULA C12H24O2 EXACTMASS 200.17763001199998 AVERAGEMASS 200.31776 SMILES CCCCCCCCC(C)CC(O)=O M END